Benzene, 1-nitro-3-(trifluoromethyl)-


Chemical Name: Benzene, 1-nitro-3-(trifluoromethyl)-
CAS Number: 98-46-4
Product Number: AG0068BU(AGN-PC-0JK82G)
Synonyms:
MDL No:
Molecular Formula: C7H4F3NO2
Molecular Weight: 191.1074

Identification/Properties


Properties
MP:
-5 °C
BP:
200-205°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.472(lit.)
Computed Properties
Molecular Weight:
191.109g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
191.019g/mol
Monoisotopic Mass:
191.019g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
199
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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